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{N-[ 3-(Hydroxymethyl)bicyclo[2.2.1]hept-5'-en-2'-yl]methyl}-3,5-dinitrobenzamide

View entire compound with spectra: 1 MS (GC)

{N-[ 3-(Hydroxymethyl)bicyclo[2.2.1]hept-5'-en-2'-yl]methyl}-3,5-dinitrobenzamide
SpectraBase Compound ID 1yJb2AW2Z64
InChI InChI=1S/C16H17N3O6/c20-8-15-10-2-1-9(3-10)14(15)7-17-16(21)11-4-12(18(22)23)6-13(5-11)19(24)25/h1-2,4-6,9-10,14-15,20H,3,7-8H2,(H,17,21)/t9-,10+,14+,15+/m1/s1
InChIKey ZTXXSIGBLSHFHT-QPNXVFALSA-N
Mol Weight 347.33 g/mol
Molecular Formula C16H17N3O6
Exact Mass 347.111735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CdYD8zZcaH6
Name {N-[ 3-(Hydroxymethyl)bicyclo[2.2.1]hept-5'-en-2'-yl]methyl}-3,5-dinitrobenzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17N3O6
InChI InChI=1S/C16H17N3O6/c20-8-15-10-2-1-9(3-10)14(15)7-17-16(21)11-4-12(18(22)23)6-13(5-11)19(24)25/h1-2,4-6,9-10,14-15,20H,3,7-8H2,(H,17,21)/t9-,10+,14+,15+/m1/s1
InChIKey ZTXXSIGBLSHFHT-QPNXVFALSA-N
Molecular Weight 347.327 g/mol
SMILES N(C(c1cc(N(=O)=O)cc(N(=O)=O)c1)=O)C[C@]1([C@@]2(C=C[C@]([C@@]1(CO)[H])(C2)[H])[H])[H]
SPLASH splash10-014i-9100000000-b930e439591b42cf3165
Source of Spectrum H-79-891-4
Synonyms N-{[3-(hydroxymethyl)bicyclo[2.2.1]hept-5-en-2-yl]methyl}-3,5-dinitrobenzamide
Wiley ID 1339924